Chemical Properties of Methyl trans-2-phenyl-1-cyclopropanecarboxylate (CAS 5861-31-4)

Methyl trans-2-phenyl-1-cyclopropanecarboxylate

InChI
InChI=1S/C11H12O2/c1-13-11(12)10-7-9(10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3/t9-,10+/m0/s1
InChI Key
BQRFZWGTJXCXSR-VHSXEESVSA-N
Formula
C11H12O2
SMILES
COC(=O)C1CC1c1ccccc1
Molecular Weight1
176.21
CAS
5861-31-4
Other Names
  • Methyl 2-phenylcyclopropanecarboxylate, trans-
  • trans-Methylcyclopropanecarboxylate, 2-methyl-2-phenyl
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Physical Properties

Property Value Unit Source
ΔfusH° 20.28 kJ/mol Joback Calculated Property
IE 8.76 eV Relay (1.0) Calculated Property
logPoct/wat 1.963 Crippen Calculated Property
McVol 138.670 ml/mol McGowan Calculated Property
Inp 1375.00 NIST
Tboil 502.88 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [333.41; 412.73] J/mol×K [556.12; 781.18] Show Hide
Cp,gas 333.41 J/mol×K 556.12 Joback Calculated Property
Cp,gas 349.06 J/mol×K 593.63 Joback Calculated Property
Cp,gas 363.68 J/mol×K 631.14 Joback Calculated Property
Cp,gas 377.31 J/mol×K 668.65 Joback Calculated Property
Cp,gas 390.00 J/mol×K 706.16 Joback Calculated Property
Cp,gas 401.79 J/mol×K 743.67 Joback Calculated Property
Cp,gas 412.73 J/mol×K 781.18 Joback Calculated Property
η [0.0004959; 0.0017296] Pa×s [326.01; 556.12] Show Hide
η 0.0017296 Pa×s 326.01 Joback Calculated Property
η 0.0012587 Pa×s 364.36 Joback Calculated Property
η 0.0009732 Pa×s 402.71 Joback Calculated Property
η 0.0007868 Pa×s 441.06 Joback Calculated Property
η 0.0006582 Pa×s 479.42 Joback Calculated Property
η 0.0005653 Pa×s 517.77 Joback Calculated Property
η 0.0004959 Pa×s 556.12 Joback Calculated Property

Similar Compounds

trans-1-Carbethoxy-2-phenylcyclopropane. Cyclopropanecarboxylic acid, trans-2-phenyl-, 2,2-dichloroethyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, isopropyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, isobutyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, butyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, but-3-yn-2-yl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, 3-methylbut-2-en-1-yl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, 2,2,3,3-tetrafluoropropyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, pentyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, 1,1,1-trifluoroprop-2-yl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, hexyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, octyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, heptadecyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, hexadecyl ester. Cyclopropanecarboxylic acid, trans-2-phenyl-, undecyl ester.

Find more compounds similar to Methyl trans-2-phenyl-1-cyclopropanecarboxylate.

Sources

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